Substrate
/
Generation 1
/
Generation 2
XenoSite
Amrubicin
CC(=O)C1(N)Cc2c(O)c3c(c(O)c2C(OC2CC(O)C(O)CO2)C1)C(=O)c1ccccc1C3=O
CHEBI
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Description
▾
Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 1
Show metabolites
CC(=O)C1(N)C=c2c(O)c3c(c(O)c2=C(OC2CC(O)C(O)CO2)C1)C(=O)c1ccccc1C3=O
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 2
Show metabolites
CC(=O)C1(O)C=c2c(O)c3c(c(O)c2=C(OC2CC(O)C(O)CO2)C1)C(=O)c1ccccc1C3=O
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 3
Select a metabolite to form the next generation.
glucuronidation
Probability 0.25
0.25
glucuronidation
Probability 0.19
0.19
glucuronidation
Probability 0.08
0.08
glucuronidation
Probability 0.06
0.06
glucuronidation
Probability 0.03
0.03